Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.53 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.53 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | TDP2 | O95551 | 2/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4842012 | 1.00 | NPSR1 (0.62) | NPSR1ALDH1A1POLBHPGDGFER | |
| SCHEMBL1233069 | 0.81 | ALDH1A1 (0.50) | NPSR1ALDH1A1POLBHPGDGFER | |
| SCHEMBL10323613 | 0.78 | CA12 (0.53) | NPSR1ALDH1A1POLBHPGDHTT | |
| SCHEMBL15910500 | 0.76 | GAA (0.60) | NPSR1ALDH1A1POLBHPGDGFER | |
| SCHEMBL21768055 | 0.75 | HTT (0.58) | ALDH1A1HPGDGFERHSD17B10HTT | |
| SCHEMBL22782798 | 0.75 | HTT (0.58) | NPSR1ALDH1A1HPGDGFERHSD17B10 | |
| SCHEMBL30512977 | 0.75 | HTT (0.58) | NPSR1ALDH1A1HPGDGFERHSD17B10 | |
| SCHEMBL11663391 | 0.74 | ALDH1A1 (0.54) | NPSR1ALDH1A1POLBHPGDGFER | |
| SCHEMBL9542535 | 0.74 | ALDH1A1 (0.90) | NPSR1ALDH1A1POLBHSD17B10HTT | |
| SCHEMBL21768027 | 0.73 | HTT (0.55) | ALDH1A1HPGDGFERHSD17B10HTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022226668-A1 | HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) | ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) | 2022-11-03 | — | — | WO | disclosed |